7-(pyridin-2-ylmethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane

Systemtic Name: 7-(pyridin-2-ylmethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane Openeye Name: 7-(2-pyridylmethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane CAS Name: 7-(2-pyridinylmethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane IUPAC Name: 7-(pyridin-2-ylmethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane Traditional Name: 7-(2-pyridylmethyl)-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane Formula: C18H31N5 MolecularWeight: 317.47224

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN2CCN(C1)CCNCCC2CC3=CC=CC=N3

Isomeric SMILES

C1CNCCN2CCN(C1)CCNCCC2CC3=CC=CC=N3

InChI

InChI=1S/C18H31N5/c1-2-7-21-17(4-1)16-18-5-8-20-9-12-22-11-3-6-19-10-13-23(18)15-14-22/h1-2,4,7,18-20H,3,5-6,8-16H2